COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK739777
Chemical Name: ethyl2-({(2E)-3-[4-(benzyloxy)phenyl]-2-cyanoprop-2-enoyl}amino)-4-(4-methylphenyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)/C(=C/c1ccc(cc1)OCc1ccccc1)/C#N

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Molecular Weight: 522.62
Empirical Formula: C31H26N2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.844
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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